Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KAT2B | Q92831 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | CCR2 | P41597 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.35 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL25145161 | 0.83 | MEN1 (0.51) | KAT2BHTTKMT2AMEN1TSHR | |
| SCHEMBL18247617 | 0.78 | KAT2B (0.40) | KAT2BHTTKMT2AMEN1TSHR | |
| SCHEMBL20532867 | 0.78 | KAT2B (0.40) | KAT2BHTTKMT2AMEN1TSHR | |
| SCHEMBL18247618 | 0.78 | KAT2B (0.40) | KAT2BHTTKMT2AMEN1TSHR | |
| SCHEMBL4098781 | 0.76 | KAT2B (0.47) | KAT2BHTTKMT2AMEN1TSHR | |
| SCHEMBL4098785 | 0.76 | KAT2B (0.47) | KAT2BHTTKMT2AMEN1TSHR | |
| SCHEMBL25145160 | 0.75 | ALDH1A1 (0.41) | HTTKMT2ATSHRALDH1A1CCR2 | |
| SCHEMBL18327523 | 0.74 | HTT (0.50) | HTTKMT2AMEN1TSHRSMN1; SMN2 | |
| SCHEMBL8175096 | 0.73 | BACE1 (0.60) | KAT2BTSHRLMNAALDH1A1KDM4E | |
| SCHEMBL8182522 | 0.73 | BACE1 (0.60) | KAT2BTSHRLMNAALDH1A1KDM4E |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016185279-A1 | BENZOIMIDAZOLE DERIVATIVES AS PAD4 INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2016-11-24 | — | — | WO | disclosed |